SCHEMBL14390693

SCHEMBL14390693

Nc1c(-c2ccoc2)cc(-c2cccs2)nc1OCc1cccc(C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACMSD Q8TDX5 2/20 0.46
▸ MRGPRX4 Q96LA9 9/20 0.41
▸ FFAR1 O14842 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX5AP P20292 1/20 0.37
▸ FEN1 P39748 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3587275 0.88 KMT2A (0.46) ACMSDMRGPRX4HPGD
SCHEMBL14390902 0.85 HPGD (0.36) ACMSDHPGD
SCHEMBL14390996 0.83 ADORA2A (0.39) HPGDALOX5APFEN1
SCHEMBL14390900 0.81 MRGPRX4 (0.41) ACMSDMRGPRX4ALOX5APFEN1
SCHEMBL14390898 0.80 KMT2A (0.40) HPGD
SCHEMBL14392510 0.80 ALDH1A1 (0.39) HPGD
SCHEMBL3580685 0.79 PDE5A (0.48) HPGD
SCHEMBL14391095 0.79 GAA (0.39) HPGD
SCHEMBL14390696 0.79 MEN1 (0.36) HPGD
SCHEMBL14390892 0.78 ALOX5AP (0.36) MRGPRX4ALOX5APFEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007124546-A1 INTEGRASE INHIBITORS 3 AVEXA LIMITED (AU) 2007-11-08 — — WO disclosed
Send feedback